Vitas-M small molecule compound

(2Z)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate

Catalog ID
STK923438
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H16O6S MW 408.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16O6S/c1-25-14-6-5-13(17(11-14)26-2)10-19-21(23)16-8-7-15(12-18(16)28-19)27-22(24)20-4-3-9-29-20/h3-12H,1-2H3/b19-10-
InChIKey
SFYDDVXIEIZQTB-GRSHGNNSSA-N
Synonyms
859139-46-1
((2Z)2((24DIMETHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)THIOPHENE2CARBOXYLATE
(2Z)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6ylthiophene2carboxylate
(Z)2(24dimethoxybenzylidene)3oxo23dihydrobenzofuran6ylthiophene2carboxylate
2((24DIMETHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLTHIOPHENE2CARBOXYLATE
859139461
COC1=CC(=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4)OC
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1
InChI=1SC22H16O6Sc125146513(17(1114)262)101921(23)168715(1218(16)2819)2722(24)204392920h312H12H3b1910
MFCD04147051
ZINC000012862953
ZINC12862953

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.